1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-[4-(dimethylamino)phenyl]tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-[4-(dimethylamino)phenyl]tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-[4-(dimethylamino)phenyl]tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | K257-0047 |
| Compound Name: | 1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-[4-(dimethylamino)phenyl]tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 588.29 |
| Molecular Formula: | C26 H21 Br Cl2 N4 O3 |
| Smiles: | CN(C)c1ccc(cc1)C1C2C(C(N(C2=O)c2ccc(cc2[Cl])[Cl])=O)N(C(c2cccc(c2)[Br])=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.675 |
| logD: | 4.6705 |
| logSw: | -5.0836 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.684 |
| InChI Key: | ODEJYUFPSLIZTF-UHFFFAOYSA-N |